CID 61151387

1249780-57-1

Structural Information

Molecular Formula
C8H15N5
SMILES
C1CCCC(CC1)(C2=NNN=N2)N
InChI
InChI=1S/C8H15N5/c9-8(7-10-12-13-11-7)5-3-1-2-4-6-8/h1-6,9H2,(H,10,11,12,13)
InChIKey
LGDBCXNGDLHRDQ-UHFFFAOYSA-N
Compound name
1-(2H-tetrazol-5-yl)cycloheptan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.13275 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.14003 139.1
[M+Na]+ 204.12197 143.7
[M-H]- 180.12547 139.5
[M+NH4]+ 199.16657 154.2
[M+K]+ 220.09591 144.0
[M+H-H2O]+ 164.13001 127.3
[M+HCOO]- 226.13095 155.0
[M+CH3COO]- 240.14660 148.8
[M+Na-2H]- 202.10742 144.0
[M]+ 181.13220 128.6
[M]- 181.13330 128.6
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.