CID 27199

1h-indole-3-carbohydrazide

Structural Information

Molecular Formula
C9H9N3O
SMILES
C1=CC=C2C(=C1)C(=CN2)C(=O)NN
InChI
InChI=1S/C9H9N3O/c10-12-9(13)7-5-11-8-4-2-1-3-6(7)8/h1-5,11H,10H2,(H,12,13)
InChIKey
QHUYDKZSGDJDSC-UHFFFAOYSA-N
Compound name
1H-indole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

142
Patents

175.07455 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.081826 133.3
[M+Na]+ 198.063768 141.9
[M-H]- 174.067274 135.5
[M+NH4]+ 193.108373 153.6
[M+K]+ 214.037708 138.2
[M+H-H2O]+ 158.071810 126.8
[M+HCOO]- 220.072751 158.1
[M+CH3COO]- 234.088401 180.3
[M+Na-2H]- 196.049216 140.8
[M]+ 175.07400142 130.9
[M]- 175.07509858 130.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe