CID 10888204

1,2,3,4-tetrahydronaphthalene-2-carbaldehyde

Structural Information

Molecular Formula
C11H12O
SMILES
C1CC2=CC=CC=C2CC1C=O
InChI
InChI=1S/C11H12O/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-4,8-9H,5-7H2
InChIKey
FITHCUPIPFVCGS-UHFFFAOYSA-N
Compound name
1,2,3,4-tetrahydronaphthalene-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

601
Patents

160.08882 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.096096 131.5
[M+Na]+ 183.078038 138.7
[M-H]- 159.081544 135.7
[M+NH4]+ 178.122643 153.4
[M+K]+ 199.051978 135.9
[M+H-H2O]+ 143.086080 125.8
[M+HCOO]- 205.087021 152.9
[M+CH3COO]- 219.102671 177.8
[M+Na-2H]- 181.063486 139.3
[M]+ 160.08827142 129.1
[M]- 160.08936858 129.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe