CID 52900

Indole-2-carbohydrazide, 5-benzyloxy-n,n-dimethyl-

Structural Information

Molecular Formula
C18H19N3O2
SMILES
CN(C)NC(=O)C1=CC2=C(N1)C=CC(=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C18H19N3O2/c1-21(2)20-18(22)17-11-14-10-15(8-9-16(14)19-17)23-12-13-6-4-3-5-7-13/h3-11,19H,12H2,1-2H3,(H,20,22)
InChIKey
SHXMHFFDHITWKE-UHFFFAOYSA-N
Compound name
N',N'-dimethyl-5-phenylmethoxy-1H-indole-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.14774 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.155016 171.2
[M+Na]+ 332.136958 177.8
[M-H]- 308.140464 177.9
[M+NH4]+ 327.181563 186.5
[M+K]+ 348.110898 173.8
[M+H-H2O]+ 292.145000 162.3
[M+HCOO]- 354.145941 195.6
[M+CH3COO]- 368.161591 210.5
[M+Na-2H]- 330.122406 176.0
[M]+ 309.14719142 173.4
[M]- 309.14828858 173.4
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.