CID 152404147

7-azido-1,2,3,4-tetrahydroquinoline

Structural Information

Molecular Formula
C9H10N4
SMILES
C1CC2=C(C=C(C=C2)N=[N+]=[N-])NC1
InChI
InChI=1S/C9H10N4/c10-13-12-8-4-3-7-2-1-5-11-9(7)6-8/h3-4,6,11H,1-2,5H2
InChIKey
XKAOYNQNKSNYQP-UHFFFAOYSA-N
Compound name
7-azido-1,2,3,4-tetrahydroquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.09055 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.097826 131.0
[M+Na]+ 197.079768 136.8
[M-H]- 173.083274 135.0
[M+NH4]+ 192.124373 150.1
[M+K]+ 213.053708 129.3
[M+H-H2O]+ 157.087810 128.1
[M+HCOO]- 219.088751 156.7
[M+CH3COO]- 233.104401 180.5
[M+Na-2H]- 195.065216 143.4
[M]+ 174.09000142 124.1
[M]- 174.09109858 124.1
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.