CID 10057988

2-amino-1,2,3,4-tetrahydronaphthalene-2-carbonitrile hydrochloride

Structural Information

Molecular Formula
C11H12N2
SMILES
C1CC(CC2=CC=CC=C21)(C#N)N
InChI
InChI=1S/C11H12N2/c12-8-11(13)6-5-9-3-1-2-4-10(9)7-11/h1-4H,5-7,13H2
InChIKey
QKYRSUCHUDXQME-UHFFFAOYSA-N
Compound name
2-amino-3,4-dihydro-1H-naphthalene-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

172.10005 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.10733 141.0
[M+Na]+ 195.08927 151.1
[M-H]- 171.09277 144.5
[M+NH4]+ 190.13387 161.6
[M+K]+ 211.06321 144.9
[M+H-H2O]+ 155.09731 129.3
[M+HCOO]- 217.09825 159.0
[M+CH3COO]- 231.11390 152.6
[M+Na-2H]- 193.07472 148.1
[M]+ 172.09950 132.0
[M]- 172.10060 132.0
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

patents stripe