CID 357113

Nsc614998

Structural Information

Molecular Formula
C11H17N3
SMILES
CC12CC3CC(C1)CC(C3)(C2)N=[N+]=[N-]
InChI
InChI=1S/C11H17N3/c1-10-3-8-2-9(4-10)6-11(5-8,7-10)13-14-12/h8-9H,2-7H2,1H3
InChIKey
ZTZVVHOMAGTOJW-UHFFFAOYSA-N
Compound name
1-azido-3-methyladamantane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.14224 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.149516 134.1
[M+Na]+ 214.131458 136.4
[M-H]- 190.134964 132.1
[M+NH4]+ 209.176063 162.0
[M+K]+ 230.105398 130.0
[M+H-H2O]+ 174.139500 131.4
[M+HCOO]- 236.140441 148.5
[M+CH3COO]- 250.156091 194.6
[M+Na-2H]- 212.116906 150.6
[M]+ 191.14169142 131.8
[M]- 191.14278858 131.8
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.