CID 3060442

1h-indole-3-acetic acid, 2-methyl-, 2-((2-hydroxyphenyl)methyl)hydrazide

Structural Information

Molecular Formula
C18H19N3O2
SMILES
CC1=C(C2=CC=CC=C2N1)CC(=O)NNCC3=CC=CC=C3O
InChI
InChI=1S/C18H19N3O2/c1-12-15(14-7-3-4-8-16(14)20-12)10-18(23)21-19-11-13-6-2-5-9-17(13)22/h2-9,19-20,22H,10-11H2,1H3,(H,21,23)
InChIKey
YIBRSIFNUKMBEW-UHFFFAOYSA-N
Compound name
N'-[(2-hydroxyphenyl)methyl]-2-(2-methyl-1H-indol-3-yl)acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.14774 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.15502 170.5
[M+Na]+ 332.13696 177.6
[M-H]- 308.14046 174.9
[M+NH4]+ 327.18156 184.9
[M+K]+ 348.11090 171.5
[M+H-H2O]+ 292.14500 162.4
[M+HCOO]- 354.14594 192.9
[M+CH3COO]- 368.16159 206.2
[M+Na-2H]- 330.12241 175.1
[M]+ 309.14719 170.2
[M]- 309.14829 170.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.