CID 170914965

1-(3,4-dihydro-2h-1-benzopyran-2-yl)cyclopropan-1-amine

Structural Information

Molecular Formula
C12H15NO
SMILES
C1CC2=CC=CC=C2OC1C3(CC3)N
InChI
InChI=1S/C12H15NO/c13-12(7-8-12)11-6-5-9-3-1-2-4-10(9)14-11/h1-4,11H,5-8,13H2
InChIKey
AMZVCRYAUOQPOV-UHFFFAOYSA-N
Compound name
1-(3,4-dihydro-2H-chromen-2-yl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.11537 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.122646 139.5
[M+Na]+ 212.104588 148.1
[M-H]- 188.108094 147.9
[M+NH4]+ 207.149193 155.4
[M+K]+ 228.078528 146.7
[M+H-H2O]+ 172.112630 133.2
[M+HCOO]- 234.113571 159.8
[M+CH3COO]- 248.129221 152.4
[M+Na-2H]- 210.090036 148.2
[M]+ 189.11482142 138.9
[M]- 189.11591858 138.9
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.