CID 28818926

1000932-36-4

Structural Information

Molecular Formula
C10H11N5
SMILES
C1CC1N2C(=NN=N2)C3=CC=CC=C3N
InChI
InChI=1S/C10H11N5/c11-9-4-2-1-3-8(9)10-12-13-14-15(10)7-5-6-7/h1-4,7H,5-6,11H2
InChIKey
KPMYWDAILDYYPN-UHFFFAOYSA-N
Compound name
2-(1-cyclopropyltetrazol-5-yl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.10144 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.108716 151.8
[M+Na]+ 224.090658 163.1
[M-H]- 200.094164 156.9
[M+NH4]+ 219.135263 162.1
[M+K]+ 240.064598 157.2
[M+H-H2O]+ 184.098700 142.0
[M+HCOO]- 246.099641 174.0
[M+CH3COO]- 260.115291 163.5
[M+Na-2H]- 222.076106 156.7
[M]+ 201.10089142 152.2
[M]- 201.10198858 152.2
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.