CID 21853388

60169-37-1

Structural Information

Molecular Formula
C11H15N3O
SMILES
C1CN(C1C(=O)NN)CC2=CC=CC=C2
InChI
InChI=1S/C11H15N3O/c12-13-11(15)10-6-7-14(10)8-9-4-2-1-3-5-9/h1-5,10H,6-8,12H2,(H,13,15)
InChIKey
BTHAKWPXUJSAGX-UHFFFAOYSA-N
Compound name
1-benzylazetidine-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.1215 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.128776 147.5
[M+Na]+ 228.110718 151.3
[M-H]- 204.114224 151.7
[M+NH4]+ 223.155323 157.4
[M+K]+ 244.084658 152.1
[M+H-H2O]+ 188.118760 133.5
[M+HCOO]- 250.119701 168.8
[M+CH3COO]- 264.135351 192.9
[M+Na-2H]- 226.096166 151.6
[M]+ 205.12095142 152.1
[M]- 205.12204858 152.1
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.